SCHEMBL1037982

SCHEMBL1037982

Cc1cc(C)c(C(=O)P(=O)(CC(=O)OCc2ccccc2)C(=O)c2c(C)cc(C)cc2C)c(C)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.45
MAPK1 P28482 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
LMNA P02545 4/20 0.42
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
HCAR2 Q8TDS4 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A3 Q01959 1/20 0.39
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
TACR1 P25103 1/20 0.38
CASP3 P42574 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
CA12 O43570 1/20 0.37
CA4 P22748 1/20 0.37
CA6 P23280 1/20 0.37
CA5A P35218 1/20 0.37
CA7 P43166 1/20 0.37
CA9 Q16790 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1039014 0.82 NLRP3 (0.44) ALDH1A1MAPK1L3MBTL1LMNANPC1
SCHEMBL1035644 0.81 LMNA (0.39) MAPK1LMNAKMT2A
SCHEMBL1037233 0.79 CETP (0.38) ALDH1A1LMNAKMT2ASMN1; SMN2
SCHEMBL7625246 0.79 LMNA (0.41) L3MBTL1LMNANPC1RAB9AKMT2A
SCHEMBL1035772 0.78 ALDH1A1 (0.37) ALDH1A1L3MBTL1LMNAKMT2ATDP1
SCHEMBL1030595 0.77 POLB (0.40) L3MBTL1LMNAKMT2ASMN1; SMN2
SCHEMBL1037378 0.77 TSHR (0.37) ALDH1A1L3MBTL1LMNAKMT2ATDP1
SCHEMBL28378069 0.77 ALDH1A1 (0.59) ALDH1A1MAPK1L3MBTL1LMNANPC1
SCHEMBL9484978 0.76 NPC1 (0.44) ALDH1A1L3MBTL1LMNANPC1RAB9A
SCHEMBL1038176 0.76 LMNA (0.47) ALDH1A1MAPK1LMNANPC1RAB9A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1814891-B1 BISACYLPHOSPHANES AND THEIR USE AS PHOTOINITIATORS; PROCESS FOR PREPARING ACYLPHOSPHANES BASF SE (DE) 2011-01-26 EP disclosed